Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.43 |
| ▸ | MEN1 | O00255 | 3/20 | 0.43 |
| ▸ | TSHR | P16473 | 2/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.40 |
| ▸ | NPC1 | O15118 | 1/20 | 0.39 |
| ▸ | RAB9A | P51151 | 1/20 | 0.39 |
| ▸ | CACNA1B | Q00975 | 1/20 | 0.39 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.38 |
| ▸ | RCE1 | Q9Y256 | 1/20 | 0.38 |
| ▸ | NR2E3 | Q9Y5X4 | 1/20 | 0.37 |
| ▸ | BRD4 | O60885 | 1/20 | 0.37 |
| ▸ | LMNA | P02545 | 1/20 | 0.37 |
| ▸ | TP53 | P04637 | 1/20 | 0.37 |
| ▸ | GAA | P10253 | 1/20 | 0.37 |
| ▸ | MAPT | P10636 | 1/20 | 0.37 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.37 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.37 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.37 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL20113756 | 0.70 | CCR1 (0.41) | ALDH1A1 | |
| SCHEMBL8305165 | 0.70 | CXCR4 (0.49) | ALDH1A1KMT2AKDM4ESMN1; SMN2HRH3 | |
| SCHEMBL28992316 | 0.70 | PDE2A (0.45) | ALDH1A1KMT2AMEN1TSHRSMN1; SMN2 | |
| SCHEMBL19018657 | 0.69 | HRH3 (0.53) | ALDH1A1KDM4ESMN1; SMN2HRH3POLB | |
| SCHEMBL7443738 | 0.69 | ALDH1A3 (0.55) | ALDH1A1KMT2AMEN1TSHRKDM4E | |
| SCHEMBL6630089 | 0.67 | ALDH1A1 (0.46) | ALDH1A1KMT2AMEN1TSHRKDM4E | |
| SCHEMBL22322105 | 0.66 | ALDH1A1 (0.56) | ALDH1A1KMT2AMEN1TSHRKDM4E | |
| SCHEMBL27318611 | 0.65 | CYP1A2 (0.52) | ALDH1A1KMT2AMEN1KDM4ESMN1; SMN2 | |
| SCHEMBL6629423 | 0.65 | CCR1 (0.50) | ALDH1A1TSHRMAPTERN1 | |
| SCHEMBL30596580 | 0.64 | GRIN2B (0.57) | KMT2AKDM4ESMN1; SMN2CACNA1BNR2E3 |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2017106634-A1 | N-PHENYL-PYRIDINE-2-CARBOXAMIDE DERIVATIVES AND THEIR USE AS PD-1/PD-L1 PROTEIN/PROTEIN INTERACTION MODULATORS | INCYTE CORPORATION (US) | 2017-06-22 | — | — | WO | disclosed |